[[4-[(3-nitrophenyl)carbonyldiazenyl]phenyl]amino] 4-methylbenzoate

Systemtic Name: [[4-[(3-nitrophenyl)carbonyldiazenyl]phenyl]amino] 4-methylbenzoate Openeye Name: [4-(3-nitrobenzoyl)azoanilino] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(3-nitrophenyl)-oxomethyl]azoanilino] ester IUPAC Name: [4-[(3-nitrobenzoyl)diazenyl]anilino] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(3-nitrobenzoyl)azoanilino] ester Formula: C21H16N4O5 MolecularWeight: 404.37554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)ONC2=CC=C(C=C2)N=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O5/c1-14-5-7-15(8-6-14)21(27)30-24-18-11-9-17(10-12-18)22-23-20(26)16-3-2-4-19(13-16)25(28)29/h2-13,24H,1H3